BDBM50028547 4-Methyl-1H-indole-5,6-diol::CHEMBL90571

SMILES: Cc1c(O)c(O)cc2[nH]ccc12

InChI Key: InChIKey=IVHNMMXKIUWNFF-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50028547   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Catechol-O-methyltransferase (Rattus norvegicus (Rat))	BDBM50028547 (4-Methyl-1H-indole-5,6-diol | CHEMBL90571) Show SMILES Cc1c(O)c(O)cc2[nH]ccc12 Show InChI InChI=1S/C9H9NO2/c1-5-6-2-3-10-7(6)4-8(11)9(5)12/h2-4,10-12H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.52E+7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Kinetic constants for the inactivation of Catechol O-methyltransferase by the compound				J Med Chem 25: 263-71 (1982) BindingDB Entry DOI: 10.7270/Q2G15ZV0
					More data for this Ligand-Target Pair